CID 76179

2901-90-8

Structural Information

Molecular Formula
C8H20O4P2S4
SMILES
CCOP(=S)(OCC)SSP(=S)(OCC)OCC
InChI
InChI=1S/C8H20O4P2S4/c1-5-9-13(15,10-6-2)17-18-14(16,11-7-3)12-8-4/h5-8H2,1-4H3
InChIKey
PJRVPYZPSNFUPX-UHFFFAOYSA-N
Compound name
(diethoxyphosphinothioyldisulfanyl)-diethoxy-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

369.97195 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 370.97923 165.3
[M+Na]+ 392.96117 168.9
[M+NH4]+ 388.00577 170.4
[M+K]+ 408.93511 160.6
[M-H]- 368.96467 162.1
[M+Na-2H]- 390.94662 163.1
[M]+ 369.97140 166.2
[M]- 369.97250 166.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe